N-butyl-2-[(5-cyano-4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-methyl-ethanamide

Systemtic Name: N-butyl-2-[(5-cyano-4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-methyl-ethanamide Openeye Name: N-butyl-2-[(5-cyano-4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-methyl-acetamide CAS Name: N-butyl-2-[(5-cyano-4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]-N-methylacetamide IUPAC Name: N-butyl-2-[(5-cyano-4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-methylacetamide Traditional Name: N-butyl-2-[(5-cyano-4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]-N-methyl-acetamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CSC1=NC(=O)C(=C(N1)C2=CC=CC=C2)C#N

Isomeric SMILES

CCCCN(C)C(=O)CSC1=NC(=O)C(=C(N1)C2=CC=CC=C2)C#N

InChI

InChI=1S/C18H20N4O2S/c1-3-4-10-22(2)15(23)12-25-18-20-16(13-8-6-5-7-9-13)14(11-19)17(24)21-18/h5-9H,3-4,10,12H2,1-2H3,(H,20,21,24)